3-[(2-Oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]benzonitrile

Base Information

• Chemical Name: 3-[(2-Oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]benzonitrile
• CAS No.: 175277-77-7
• Molecular Formula: C15H10 N2 O2
• Molecular Weight: 250.25
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID00372613
• Wikidata: Q82160416
• Mol file: 175277-77-7.mol

Synonyms:175277-77-7;3-[(2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]benzonitrile;3-[(2-oxo-1,3-benzoxazol-3-yl)methyl]benzonitrile;3-((2-Oxobenzo[d]oxazol-3(2H)-yl)methyl)benzonitrile;Benzonitrile, 3-[(2-oxo-3(2H)-benzoxazolyl)methyl]-;Maybridge1_008862;Oprea1_012982;Benzonitrile,3-[(2-oxo-3(2H)-benzoxazolyl)methyl]-;HMS566K18;DTXSID00372613;MFCD00204240;SPB 06722;AKOS000184644;FT-0614801;3-[(2-Oxo-1,3-benzoxazol-3(2H)-yl)methyl]benzonitrile

Chemical Property of 3-[(2-Oxo-2,3-dihydro-1,3-benzoxazol-3-yl)methyl]benzonitrile

Chemical Property:

• Vapor Pressure: 7.01E-08mmHg at 25°C
• Boiling Point: 438.2°Cat760mmHg
• Flash Point: 218.8°C
• PSA: 58.93000
• Density: 1.36g/cm³
• LogP: 2.51448
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 250.074227566
• Heavy Atom Count: 19
• Complexity: 400

Purity/Quality:

98%min ^*data from raw suppliers

3-[(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)METHYL]BENZONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C(=O)O2)CC3=CC(=CC=C3)C#N